N-(4-chlorophenyl)-N-[(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]-4-fluorobenzamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-N-[(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]-4-fluorobenzamide
N-(4-chlorophenyl)-N-[(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]-4-fluorobenzamide
Compound characteristics
| Compound ID: | D433-0216 |
| Compound Name: | N-(4-chlorophenyl)-N-[(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]-4-fluorobenzamide |
| Molecular Weight: | 409.85 |
| Molecular Formula: | C21 H17 Cl F N5 O |
| Smiles: | Cc1cc(C)n2c(n1)nc(CN(C(c1ccc(cc1)F)=O)c1ccc(cc1)[Cl])n2 |
| Stereo: | ACHIRAL |
| logP: | 3.5379 |
| logD: | 3.5379 |
| logSw: | -4.0143 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.171 |
| InChI Key: | QVHVXAKMQIYUTA-UHFFFAOYSA-N |